Role of the range of intermolecular interactions in fluids

被引:6
|
作者
Nezbeda, I [1 ]
机构
[1] Acad Sci Czech Republ, E Hala Lab Thermodynam, ICPF, CR-16502 Prague 6, Czech Republic
[2] JE Purkyne Univ, Dept Phys, Usti Nad Labem 40096, Czech Republic
关键词
site-site distribution functions; short-range repulsions; long-range interactions; dielectric constant; polar fluids; associating fluids;
D O I
10.1016/j.cocis.2004.05.013
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Using available realistic effective pair potentials and their variants involving forces of different range, the role of the range of interactions on the structure of pure polar and associating fluids has been investigated. Systematic computer simulations performed lead to the unambiguous conclusion that the structural properties of both types of fluids are governed by the same molecular mechanism as normal fluids, i.e. by the short-range interactions, whereas the long-range part of electrostatic forces, regardless of their strength, plays only a marginal role and may be treated as a perturbation only. Consequences of this finding and their limits are then shortly discussed. (C) 2004 Elsevier Ltd. All rights reserved.
引用
收藏
页码:107 / 111
页数:5
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